Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.47 |
| ▸ | HTR2A | P28223 | 1/20 | 0.46 |
| ▸ | HTR2C | P28335 | 1/20 | 0.46 |
| ▸ | CYP11B2 | P19099 | 7/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP11B1 | P15538 | 5/20 | 0.44 |
| ▸ | CA12 | O43570 | 5/20 | 0.44 |
| ▸ | CA1 | P00915 | 5/20 | 0.44 |
| ▸ | CA2 | P00918 | 5/20 | 0.44 |
| ▸ | CA7 | P43166 | 5/20 | 0.44 |
| ▸ | CA9 | Q16790 | 5/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 5/20 | 0.44 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.41 |
| ▸ | LHCGR | P22888 | 1/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.41 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL31083687 | 0.79 | CYP11B2 (0.44) | CYP11B2CYP11B1 | |
| SCHEMBL31070639 | 0.76 | TRPM8 (0.43) | CYP11B2TRPM8LHCGR | |
| SCHEMBL31083750 | 0.76 | KDR (0.38) | ESR1ESR2CYP11B2CYP11B1CA12 | |
| SCHEMBL30593227 | 0.74 | ECE1 (0.44) | ESR1ESR2 | |
| SCHEMBL30593239 | 0.74 | DRD2 (0.41) | ESR1ESR2HTR2ACA12CA1 | |
| SCHEMBL25604564 | 0.74 | HHAT (0.57) | ESR1ESR2CA12CA1CA2 | |
| SCHEMBL31083691 | 0.73 | KIF11 (0.41) | — | |
| SCHEMBL19378992 | 0.73 | TRPM8 (0.43) | CYP3A4TRPM8LHCGR | |
| SCHEMBL30593219 | 0.72 | AURKA (0.43) | — | |
| SCHEMBL29084871 | 0.72 | HSD11B1 (0.40) | ESR1ESR2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116789641-A | Dihydro isoquinoline compound and medical application thereof | 中国科学院上海药物研究所 | 2023-09-22 | — | — | CN | disclosed |